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P-889867285

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Name File
SDF P-889867285.sdf
SMILES P-889867285.smiles
Standard InChI P-889867285.inchi
InChIKey P-889867285.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-889867285 Princeton Biomolecular Research Building Blocks Synthesis 95 by synthesis
Property Value
Components 2
Mass 475.530
logP 1.5841
H-bond acceptors 9
H-bond donors 6
Rotatable bonds 8
PSA 158.76
RO5 violations 1
RO3 violations 5
Refractivity 129.442
Atoms 67
Rings 3
Heavy atoms 34
Hydrogen atoms 33
Heteroatoms 9
N/O atoms 9
Inorganic atoms 0
Halogen atoms 0
Chiral centers 4
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 4
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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